A finite-difference Newton-Raphson solution of the two-center electronic Schrödinger equation

DOI10.1016/0021-9991(74)90094-1zbMath0289.65042OpenAlexW1980456446MaRDI QIDQ1847135

Yanyan Li

Publication date: 1974

Published in: Journal of Computational Physics (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1016/0021-9991(74)90094-1

Mathematics Subject Classification ID

Numerical solution of boundary value problems involving ordinary differential equations (65L10) Applications to the sciences (65Z05)

Related Items (3)

Continuum wave functions for the two-center, one-electron system ⋮ Continuum solutions to the two-center Coulomb problem in prolate spheroidal coordinates ⋮ \texttt{Dftatom}: a robust and general Schrödinger and Dirac solver for atomic structure calculations

Cites Work

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• A finite difference Newton-Raphson solution of the atomic Hartree-Fock problem
• Wave functions of the hydrogen molecular ion

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